methyl 2,3,4-trifluoro-5-nitrobenzoate

methyl 2,3,4-trifluoro-5-nitrobenzoate

CAS: 918321-24-1

Formula: C8H4F3NO4

SMILES: COC(=O)C1=CC(=C(F)C(F)=C1F)[N+]([O-])=O

IUPAC: methyl 2,3,4-trifluoro-5-nitrobenzoate

InChI: InChI=1S/C8H4F3NO4/c1-16-8(13)3-2-4(12(14)15)6(10)7(11)5(3)9/h2H,1H3

Composition: C (40.87%), H (1.71%), F (24.24%), N (5.96%), O (27.22%)

Molar Mass: 235.118

Atom Count: 20

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	235.009242102
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	KLHGRWQHRLWLEB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.05
Topological Polar Surface Area	69.44
Polarizability	16.35
Ring Count	1
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	918321-24-1		$13.87-$117.27$13.87$34.05$117.27

LabNetwork INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	1 Day	918321-24-1		$261.90$261.90